SCHEMBL25464591

SCHEMBL25464591

O=C(NC1CC1)C1(c2ccc(Cl)cc2)CCCC1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.67
HSD11B1 P28845 4/20 0.54
AVPR1A P37288 4/20 0.53
HDAC1 Q13547 1/20 0.52
LMNA P02545 1/20 0.51
ALDH1A1 P00352 3/20 0.51
IDO1 P14902 1/20 0.51
FFAR2 O15552 2/20 0.49
CCR8 P51685 1/20 0.48
EPHX1 P07099 1/20 0.48
POLB P06746 1/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25464152 0.98 HDAC4 (0.65) HDAC4HSD11B1AVPR1AHDAC1LMNA
SCHEMBL25464161 0.95 HDAC4 (0.65) HDAC4HSD11B1AVPR1AHDAC1ALDH1A1
SCHEMBL4961970 0.89 POLB (0.57) HDAC4HSD11B1AVPR1AALDH1A1IDO1
SCHEMBL4964872 0.88 HDAC4 (0.51) HDAC4HSD11B1AVPR1ALMNAIDO1
SCHEMBL25464156 0.87 IDO1 (0.54) HDAC4HSD11B1AVPR1ALMNAALDH1A1
SCHEMBL3517801 0.82 SLC6A4 (0.56) HDAC4HDAC1ALDH1A1IDO1CCR8
SCHEMBL25464568 0.82 IDO1 (0.55) HDAC4LMNAALDH1A1IDO1CCR8
Hydrochloric Acid SCHEMBL4000831 0.82 HDAC4 (0.52) HDAC4HSD11B1AVPR1AHDAC1ALDH1A1
SCHEMBL16132869 0.80 HDAC4 (1.00) HDAC4HSD11B1HDAC1ALDH1A1FFAR2
SCHEMBL25464360 0.80 AVPR1A (0.55) HDAC4AVPR1ALMNAALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230151074-A1 MODULATORS OF G-PROTEIN COUPLED RECEPTORS CARMOT THERAPEUTICS, INC. 2023-05-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230151074-A1 MODULATORS OF G-PROTEIN COUPLED RECEPTORS GIPR, GLP1R, GCGR HDAC4 2192/4885HSD11B1 2569/4885AVPR1A 198/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.